In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2005 | 27 | No |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.85 | 8.6 | -14.72 | 0 | 5 | 0 | 76 | 378.453 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.85 | 9.21 | -32.92 | 1 | 5 | 1 | 78 | 379.461 | 4 | ↓ |